[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate

Systemtic Name: [2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl] (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate Openeye Name: [2-(2-methylindolin-1-yl)-2-oxo-ethyl] (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-2-propenoic acid [2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl] (E)-3-(1,3-benzodioxol-5-yl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-acrylic acid [2-keto-2-(2-methylindolin-1-yl)ethyl] ester Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)COC(=O)C(=CC3=CC4=C(C=C3)OCO4)C#N

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)COC(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/C#N

InChI

InChI=1S/C22H18N2O5/c1-14-8-16-4-2-3-5-18(16)24(14)21(25)12-27-22(26)17(11-23)9-15-6-7-19-20(10-15)29-13-28-19/h2-7,9-10,14H,8,12-13H2,1H3/b17-9+